4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=150.20866197303332 stress="-8.570469576098892 0.03134888726423662 -0.005652298112633581 0.03134888726423662 -4.753248572673193 -0.03677228301694466 -0.005652298112633581 -0.03677228301694466 -9.17223537263108" free_energy=150.20866197303332 pbc="T F T" Sr 0.03848316 0.19178619 0.17895518 11.62891296 -46.01804269 -10.83705197 Sr 1.79140871 1.61455359 0.09583508 -15.81994262 51.87748512 -6.24927937 Sr 1.64904689 0.10609294 1.46603997 -13.92590077 -50.30761668 7.74987376 Sr -0.19401975 1.32157598 1.51361598 18.11693043 44.44817424 9.33645757